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3,5-Ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine
SpectraBase Compound ID A6zawe8QPQD
InChI InChI=1S/C31H54N2/c1-28(2,3)24-14-18-32(22-26(20-24)30(7,8)9)16-13-17-33-19-15-25(29(4,5)6)21-27(23-33)31(10,11)12/h14-15,20-21H,13,16-19,22-23H2,1-12H3
InChIKey GOKRSPLPRQRRTD-UHFFFAOYSA-N
Mol Weight 454.8 g/mol
Molecular Formula C31H54N2
Exact Mass 454.4287 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2844X4l2Dg
Name 3,5-Ditert-butyl-1-[3-(3,5-ditert-butyl-2,7-dihydroazepin-1-yl)propyl]-2,7-dihydroazepine
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Formula C31H54N2
InChI InChI=1S/C31H54N2/c1-28(2,3)24-14-18-32(22-26(20-24)30(7,8)9)16-13-17-33-19-15-25(29(4,5)6)21-27(23-33)31(10,11)12/h14-15,20-21H,13,16-19,22-23H2,1-12H3
InChIKey GOKRSPLPRQRRTD-UHFFFAOYSA-N
Molecular Weight 454.787 g/mol
SMILES C1(=CC(=CCN(C1)CCCN1CC(=CC(=CC1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C
SPLASH splash10-0r6r-6492800000-c0d2acf357b2331e7d5a
Source of Spectrum KC-0-3662-5
Wiley ID 829616